3-(dimethylamino)-1-(4-methoxynaphthalen-1-yl)propan-1-one(CAS No. 5471-09-0) CAS NO.5471-09-0

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Product Details

Keywords

3-(dimethylamino)-1-(4-methoxy-1-naphthyl)-1-propanone
5471-09-0
98%

Quick Details

ProName: 3-(dimethylamino)-1-(4-methoxynaphthal...
CasNo: 5471-09-0
Molecular Formula: C16H19NO2
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram

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Details

【Name】
3-(dimethylamino)-1-(4-methoxynaphthalen-1-yl)propan-1-one
【Iupac name】
3-(dimethylamino)-1-(4-methoxynaphthalen-1-yl)propan-1-one
【CAS Registry number】
5471-09-0
【Synonyms】
3-(dimethylamino)-1-(4-methoxy-1-naphthyl)-1-propanone
【Molecular Formula】
C16H19NO2 (Products with the same molecular formula)
【Molecular Weight】
257.3276
【Inchi】
InChI=1/C16H19NO2/c1-17(2)11-10-15(18)13-8-9-16(19-3)14-7-5-4-6-12(13)14/h4-9H,10-11H2,1-3H3
【Canonical SMILES】
CN(C)CCC(=O)C1=CC=C(C2=CC=CC=C21)OC
【MOL File】
5471-09-0.mol
Chemical and Physical Properties
【Density】
1.091g/cm3
【Boiling Point】
412.8°C at 760 mmHg
【Refractive Index】
1.579
【Flash Point】
203.5°C
【Computed Properties】
Molecular Weight:257.32756 [g/mol]
Molecular Formula:C16H19NO2
XLogP3-AA:2.8
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:5
Tautomer Count:2
Exact Mass:257.141579
MonoIsotopic Mass:257.141579
Topological Polar Surface Area:29.5
Heavy Atom Count:19
Formal Charge:0
Complexity:303
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Cation Count:1
Feature 3D Ring Count:2
Effective Rotor Count:5
Conformer Sampling RMSD:0.6
CID Conformer Count:96

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